Vitas-M small molecule compound
N-[(E)-{5-[(3-chloro-2-methylphenoxy)methyl]furan-2-yl}methylidene]-3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STL173473
SMILES CCSc1nncn1/N=C/c1ccc(o1)COc1cccc(c1C)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H17ClN4O2S MW 376.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN4O2S/c1-3-25-17-21-19-11-22(17)20-9-13-7-8-14(24-13)10-23-16-6-4-5-15(18)12(16)2/h4-9,11H,3,10H2,1-2H3/b20-9+InChIKey
RQOZRLNQXHSOBX-AWQFTUOYSA-NSynonyms
866741-42-6(E)1(5((3chloro2methylphenoxy)methyl)furan2yl)N(3ethylsulfanyl124triazol4yl)methanimine
866741426
CCSC1=NN=CN1N=CC2=CC=C(O2)COC3=C(C(=CC=C3)Cl)C
CCSc1nncn1N=Cc1ccc(o1)COc1cccc(c1C)Cl
InChI=1SC17H17ClN4O2Sc13251721191122(17)209137814(2413)10231664515(18)12(16)2h4911H310H212H3b209+
MFCD06196013
N((E)(5((3chloro2methylphenoxy)methyl)furan2yl)methylidene)3(ethylsulfanyl)4H124triazol4amine
ZINC000036611439
ZINC96569492
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